ethyl 2-(2,6-dimethyl-3-phenyl-phenyl)-4-[(4-methoxyphenyl)methylsulfanyl]-4-methyl-3-oxidanylidene-pentanoate

Systemtic Name: ethyl 2-(2,6-dimethyl-3-phenyl-phenyl)-4-[(4-methoxyphenyl)methylsulfanyl]-4-methyl-3-oxidanylidene-pentanoate Openeye Name: ethyl 2-(2,6-dimethyl-3-phenyl-phenyl)-4-[(4-methoxyphenyl)methylsulfanyl]-4-methyl-3-oxo-pentanoate CAS Name: 2-(2,6-dimethyl-3-phenylphenyl)-4-[(4-methoxyphenyl)methylthio]-4-methyl-3-oxopentanoic acid ethyl ester IUPAC Name: ethyl 2-(2,6-dimethyl-3-phenylphenyl)-4-[(4-methoxyphenyl)methylsulfanyl]-4-methyl-3-oxopentanoate Traditional Name: 2-(2,6-dimethyl-3-phenyl-phenyl)-3-keto-4-methyl-4-(p-anisylthio)valeric acid ethyl ester Formula: C30H34O4S MolecularWeight: 490.65356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(C=CC(=C1C)C2=CC=CC=C2)C)C(=O)C(C)(C)SCC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C(C1=C(C=CC(=C1C)C2=CC=CC=C2)C)C(=O)C(C)(C)SCC3=CC=C(C=C3)OC

InChI

InChI=1S/C30H34O4S/c1-7-34-29(32)27(26-20(2)13-18-25(21(26)3)23-11-9-8-10-12-23)28(31)30(4,5)35-19-22-14-16-24(33-6)17-15-22/h8-18,27H,7,19H2,1-6H3